%chk=000062370.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062370

0 1
 O   -4.935100      -1.437200     -5.4099999E-02
 N   0.8871000     -0.5878000      -1.086400    
 N   -2.813000     -0.5110000     -0.4423000    
 C  -0.3310000     -0.3230000     -0.3193000    
 C   -1.544800     -0.7441000      -1.151000    
 C    2.068200     -0.1937000     -0.3201000    
 C  -0.2523000      -1.076500       1.007900    
 C    3.352100     -0.5634000      -1.063900    
 C   0.8476000      0.1185000      -2.365800    
 C   -3.152100      0.8387000     -3.7999999E-02
 C    4.578600     -0.1823000     -0.2738000    
 C   -3.710800      -1.559800     -0.1429000    
 C   -3.077600      -2.922800      0.1224000    
 C   -3.918500       1.000700       1.084500    
 C   -2.686400       1.875400     -0.8008000    
 C    5.137000       1.075200     -0.4474000    
 C    5.127800      -1.095300      0.6139000    
 C   -3.895600      -3.776800       1.079000    
 C   -4.244700       2.299700       1.474100    
 C   -3.012600       3.174500     -0.4109000    
 C    6.271400       1.427900      0.2835000    
 C    6.262200     -0.7425000       1.345000    
 C   -3.791800       3.386500      0.7264000    
 C    6.834000      0.5191000       1.179800    
 H  -0.3867000      0.7463000     -8.2500003E-02
 H   -1.650400     -0.2223000      -2.104500    
 H   -1.463400      -1.802500      -1.423000    
 H    2.054200      0.8810000     -9.2600003E-02
 H    2.130000     -0.7243000      0.6345000    
 H   4.2900000E-02  -2.123200      0.8744000    
 H   0.4438000     -0.6073000       1.711500    
 H   -1.210000      -1.058000       1.537700    
 H    3.447000     -6.2799998E-02  -2.032200    
 H    3.373500      -1.640400      -1.278400    
 H   7.1400002E-02 -0.2684000      -3.031800    
 H    1.744800     -3.4400001E-02  -2.969600    
 H   0.7042000       1.198400      -2.242800    
 H   -2.079300      -2.824300      0.5403000    
 H   -2.992200      -3.441700     -0.8390000    
 H   -4.253300      0.1802000       1.709800    
 H   -2.097800       1.757700      -1.702200    
 H    4.705000       1.791400      -1.140500    
 H    4.688700      -2.079400      0.7509000    
 H   -3.394500      -4.732500       1.261100    
 H   -4.889400      -3.987300      0.6703000    
 H   -4.028400      -3.267700       2.039300    
 H   -4.843700       2.465700       2.364800    
 H   -2.663800       4.021200     -0.9951000    
 H    6.716100       2.410500      0.1556000    
 H    6.699900      -1.449700       2.043300    
 H   -4.044800       4.398000       1.030500    
 H    7.717100      0.7939000       1.749300    


%chk=000062370-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062370

0 1
O -4.575513 -1.565231 0.985661
N 0.881928 0.182234 -0.855569
N -2.765542 -0.606951 -0.143523
C -0.328307 0.108990 0.029581
C -1.411466 -0.706118 -0.748025
C 2.209891 0.185954 -0.198198
C -0.082985 -0.525244 1.410828
C 3.359300 -0.196695 -1.174478
C 0.759604 1.283354 -1.839824
C -3.403010 0.695888 -0.188022
C 4.683030 -0.327772 -0.436497
C -3.432885 -1.697008 0.453582
C -2.734223 -3.069631 0.411754
C -3.981390 1.260700 0.976828
C -3.439498 1.423865 -1.404292
C 5.479245 0.816236 -0.167669
C 5.130259 -1.586934 0.041353
C -3.582301 -4.158774 1.093840
C -4.578804 2.537682 0.921071
C -4.031262 2.705558 -1.451334
C 6.687413 0.707491 0.557254
C 6.338400 -1.701934 0.766115
C -4.603173 3.270161 -0.288872
C 7.121328 -0.553653 1.028117
H -0.731808 1.136096 0.202624
H -1.444726 -0.356766 -1.794851
H -1.088954 -1.755895 -0.783845
H 2.449586 1.179283 0.262549
H 2.211617 -0.555706 0.616052
H 0.347355 -1.540830 1.325188
H 0.585959 0.087766 2.038356
H -1.049224 -0.607256 1.939893
H 3.450863 0.566807 -1.969438
H 3.080975 -1.149240 -1.662140
H -0.253474 1.300046 -2.276333
H 1.474063 1.147118 -2.669281
H 0.943894 2.286308 -1.380015
H -1.743382 -3.000573 0.901735
H -2.540400 -3.350575 -0.642990
H -3.978565 0.692790 1.909829
H -3.030989 0.983914 -2.320634
H 5.153540 1.796763 -0.537939
H 4.530661 -2.482992 -0.163459
H -3.062722 -5.133014 1.045345
H -4.566013 -4.254367 0.605169
H -3.770329 -3.907932 2.151205
H -5.026180 2.961308 1.827137
H -4.055544 3.254568 -2.399393
H 7.291006 1.601636 0.751224
H 6.670722 -2.684085 1.121701
H -5.066724 4.261973 -0.326261
H 8.059356 -0.641212 1.587791


